Crystallography Open Database

Information card for entry 7118597

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Coordinates	7118597.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H66 N4 O4
Calculated formula	C58 H66 N4 O4
Title of publication	Rh(ii)-Catalyzed formation of pyrrolo[2,3-b]quinolines from azide-methylenecyclopropanes and isonitriles.
Authors of publication	Chen, Kai; Tang, Xiang-Ying; Shi, Min
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2016
Journal volume	52
Journal issue	9
Pages of publication	1967 - 1970
a	10.372 ± 0.0001 Å
b	12.1576 ± 0.0001 Å
c	21.0058 ± 0.0002 Å
α	77.946 ± 0.001°
β	84.483 ± 0.001°
γ	80.041 ± 0.001°
Cell volume	2546.41 ± 0.04 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0517
Residual factor for significantly intense reflections	0.0444
Weighted residual factors for significantly intense reflections	0.1255
Weighted residual factors for all reflections included in the refinement	0.1347
Goodness-of-fit parameter for all reflections included in the refinement	1.003
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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